In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 26 | Yes |
Popular Name: (1S)-2-(4-chlorophenyl)sulfonyl-1-[(2R)-1-methylpyrrolidin-2-yl]-3,4-dihydro-1H-isoquinoline (1S)-2-(4-chlorophenyl)sulfonyl-…
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) | 3.92 | 9.3 | -42.19 | 1 | 4 | 1 | 42 | 391.944 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.92 | 7.32 | -7.99 | 0 | 4 | 0 | 41 | 390.936 | 3 | ↓ |