In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | No |
Popular Name: 2-[(4-fluorophenyl)methylamino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide 2-[(4-fluorophenyl)methylamino]-…
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) | 3.09 | 7.67 | -12.24 | 3 | 3 | 0 | 51 | 301.39 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 8 | -41.58 | 4 | 3 | 1 | 52 | 302.398 | 4 | ↓ |