In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: 4-(aminomethyl)-N-(5-chloro-2-cyano-phenyl)benzamide 4-(aminomethyl)-N-(5-chloro-2-cy…
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) | 2.37 | 5.53 | -53.78 | 4 | 4 | 1 | 81 | 286.742 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 5.13 | -8.23 | 3 | 4 | 0 | 79 | 285.734 | 3 | ↓ |