In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | No |
Popular Name: (4S)-N-[(4-dimethylaminophenyl)methyl]isothiochroman-4-amine (4S)-N-[(4-dimethylaminophenyl)m…
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) | 3.49 | 10.11 | -41.53 | 2 | 2 | 1 | 20 | 299.463 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.49 | 8.88 | -4.22 | 1 | 2 | 0 | 15 | 298.455 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.