In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 24 | Yes |
Popular Name: 2-[(3-cyano-1-pyrindan-2-yl)thio]-N-phenethyl-acetamide 2-[(3-cyano-1-pyrindan-2-yl)thio…
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) | 3.13 | -0.67 | -14.49 | 1 | 4 | 0 | 65 | 337.448 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.13 | -0.57 | -46.81 | 2 | 4 | 1 | 67 | 338.456 | 6 | ↓ |