In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 21 | No |
Popular Name: (2R)-1-[2-[(3-carbamothioylphenyl)amino]-2-oxo-ethyl]pyrrolidine-2-carboxamide (2R)-1-[2-[(3-carbamothioylpheny…
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) | 0.97 | 2.01 | -56.36 | 6 | 6 | 1 | 103 | 307.399 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.97 | -0.17 | -38.05 | 5 | 6 | 0 | 101 | 306.391 | 5 | ↓ |