In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 21 | No |
Popular Name: 2-(4-cyclopropylpiperazine-1-carbonyl)-2-propyl-pentanethioamide 2-(4-cyclopropylpiperazine-1-car…
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) | 1.78 | 4.9 | -4.93 | 2 | 4 | 0 | 50 | 311.495 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 7.06 | -37.78 | 3 | 4 | 1 | 51 | 312.503 | 7 | ↓ |