In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 16 | Yes |
Popular Name: (1S)-N-(cyclopropylmethyl)-N',N'-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N-(cyclopropylmethyl)-N',N'…
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) | 2.58 | 8.73 | -112.2 | 3 | 2 | 2 | 21 | 220.36 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 6.9 | -32.45 | 2 | 2 | 1 | 20 | 219.352 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 7.65 | -34.79 | 2 | 2 | 1 | 16 | 219.352 | 6 | ↓ |