In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 32 | No |
Popular Name: (3Z)-1-[(4-benzyl-1-piperidyl)methyl]-3-(4-bromophenyl)imino-indolin-2-one (3Z)-1-[(4-benzyl-1-piperidyl)me…
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) | 6.71 | 13.45 | -8.65 | 0 | 4 | 0 | 38 | 488.429 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.71 | 15.48 | -47.17 | 1 | 4 | 1 | 39 | 489.437 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.71 | 15.75 | -46.02 | 1 | 4 | 1 | 39 | 489.437 | 5 | ↓ |