In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 24 | Yes |
Popular Name: 3-[[4-(m-tolylmethyl)piperazin-1-yl]methyl]-1H-indole 3-[[4-(m-tolylmethyl)piperazin-1…
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) | 3.61 | 9.99 | -38.9 | 2 | 3 | 1 | 23 | 320.46 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 10 | -38.12 | 2 | 3 | 1 | 23 | 320.46 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 7.68 | -7.57 | 1 | 3 | 0 | 22 | 319.452 | 4 | ↓ |