In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 19 | Yes |
Popular Name: (2R)-3-(4-benzylpiperazin-1-yl)-2-methyl-propanamidine (2R)-3-(4-benzylpiperazin-1-yl)-…
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) | 1.47 | 5.13 | -84.93 | 5 | 4 | 2 | 59 | 262.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 4.86 | -102.54 | 5 | 4 | 2 | 59 | 262.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 2.87 | -33.32 | 4 | 4 | 1 | 58 | 261.393 | 5 | ↓ |