In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 18 | Yes |
Popular Name: (2S,3S)-3-methyl-2-[(4-methylpiperazine-1-carbonyl)amino]pentanoic (2S,3S)-3-methyl-2-[(4-methylpip…
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) | -0.16 | 5.4 | -80.11 | 2 | 6 | 0 | 77 | 257.334 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.16 | 3.01 | -57.28 | 1 | 6 | -1 | 76 | 256.326 | 4 | ↓ |