(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)imino-triphenyl-lambda5-phosphane
Formula:C35H26N5P
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)imino-triphenyl-lambda5-phosphane is not a drug-like molecule.
| MolName | (4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)imino-triphenyl-lambda5-phosphane |
| MolecularFormula | C35H26N5P |
| Smiles | c(cc1)ccc1-c1c2c(N=P(c3ccccc3)(c3ccccc3)c3ccccc3)n[nH]c2nnc1-c1ccccc1 |
| InChI | InChI=1S/C35H26N5P/c1-6-16-26(17-7-1)31-32-34(37-36-33(31)27-18-8-2-9-19-27)38-39-35(32)40-41(28-20-10-3-11-21-28,29-22-12-4-13-23-29)30-24-14-5-15-25-30/h1-25H,(H,37,38,39) |
| InChIK | ADLDVGDFIZNUQP-UHFFFAOYSA-N |
| TotalMolweight | 547.6 |
| Molweight | 547.6 |
| MonoisotopicMass | 547.192582 |
| CLogP | 7.8287 |
| CLogS | -10.867 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 421.5 |
| Relative PSA | 0.14802 |
| PolarSurfaceArea | 76.63 |
| Druglikeness | -10.103 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.34146 |
| Fragments | 1 |
| Non HAtoms | 41 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 7 |
| Small Rings | 7 |
| Aromatic Rings | 7 |
| Aromatic Atoms | 39 |
| Sp3Atoms | 1 |
| Symmetricatoms | 18 |
| Aromatic Nitrogens | 4 |
| StereoCon |
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