In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 30 | Yes |
Popular Name: N-(3H-benzo[e]benzimidazol-2-ylmethyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]methanamine N-(3H-benzo[e]benzimidazol-2-ylm…
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) | 3.87 | 10.08 | -44.78 | 3 | 6 | 1 | 58 | 402.522 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.87 | 8.81 | -48.72 | 3 | 6 | 1 | 61 | 402.522 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.87 | 7.68 | -9.48 | 2 | 6 | 0 | 56 | 401.514 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.87 | 10.87 | -102.03 | 4 | 6 | 2 | 59 | 403.53 | 6 | ↓ |