In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 21 | Yes |
Popular Name: (3S,5S)-N-[3-(benzimidazol-1-yl)propyl]-5-methyl-heptan-3-amine (3S,5S)-N-[3-(benzimidazol-1-yl)…
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) | 4.31 | 11.46 | -50.88 | 2 | 3 | 1 | 34 | 288.459 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | 11.9 | -100.07 | 3 | 3 | 2 | 36 | 289.467 | 9 | ↓ |