In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 18 | Yes |
Popular Name: N-methyl-1-[(6S)-6-phenyl-4,5,6,7-tetrahydro-1H-benzimidazol-2-yl]methanamine N-methyl-1-[(6S)-6-phenyl-4,5,6,…
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) | 2.63 | 6.19 | -28.51 | 3 | 3 | 1 | 42 | 242.346 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.63 | 5.49 | -5.81 | 2 | 3 | 0 | 41 | 241.338 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 6.92 | -42.13 | 3 | 3 | 1 | 45 | 242.346 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.