In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 21 | Yes |
Popular Name: N-[4-(aminomethyl)phenyl]-3-(4-ethylpiperazin-1-yl)propanamide N-[4-(aminomethyl)phenyl]-3-(4-e…
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) | 0.87 | 3.64 | -90.81 | 5 | 5 | 2 | 64 | 292.427 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.87 | 1.34 | -52.42 | 4 | 5 | 1 | 63 | 291.419 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.87 | 3.65 | -96.03 | 5 | 5 | 2 | 64 | 292.427 | 6 | ↓ |