In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2007 | 25 | Yes |
Popular Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-(2-pyridylsulfanyl)acetamide N-(3-cyano-1-cyclopentyl-4,5-dim…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.23 | 1.62 | -17.35 | 1 | 5 | 0 | 70 | 354.479 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 1.76 | -47.44 | 2 | 5 | 1 | 71 | 355.487 | 5 | ↓ |