In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 21 | Yes |
Popular Name: N-[(5-chloro-2-methoxy-phenyl)methyl]-3-(4-methylpiperazin-1-yl)propan-1-amine N-[(5-chloro-2-methoxy-phenyl)me…
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) | 2.35 | 6.62 | -87.05 | 3 | 4 | 2 | 34 | 313.873 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 6.51 | -106.56 | 3 | 4 | 2 | 34 | 313.873 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 4.24 | -40.23 | 2 | 4 | 1 | 32 | 312.865 | 7 | ↓ |