In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2006 | 29 | Yes |
Popular Name: 1-benzyl-3-[(3-fluorophenyl)methylaminomethyl]indole-2-carboxylic 1-benzyl-3-[(3-fluorophenyl)meth…
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) | 4.66 | 13.96 | -44.36 | 2 | 4 | 0 | 62 | 388.442 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.66 | 12.59 | -55.09 | 1 | 4 | -1 | 57 | 387.434 | 7 | ↓ |